Cas no 51235-79-1 (1,3,5-Triazine-2,4(1H,3H)-dione, 3-ethyl-1-methyl-6-(methylamino)-)
51235-79-1 structure
Product Name:1,3,5-Triazine-2,4(1H,3H)-dione, 3-ethyl-1-methyl-6-(methylamino)-
CAS No:51235-79-1
MF:C7H12N4O2
MW:184.195780754089
CID:362814
PubChem ID:21509646
Update Time:2025-04-19
1,3,5-Triazine-2,4(1H,3H)-dione, 3-ethyl-1-methyl-6-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazine-2,4(1H,3H)-dione, 3-ethyl-1-methyl-6-(methylamino)-
- 3-ethyl-1-methyl-6-(methylamino)-1,3,5-triazine-2,4-dione
- DTXSID60615311
- 51235-79-1
- SCHEMBL11839276
- 3-Ethyl-1-methyl-6-(methylamino)-1,3,5-triazine-2,4(1H,3H)-dione
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- Inchi： 1S/C7H12N4O2/c1-4-11-6(12)9-5(8-2)10(3)7(11)13/h4H2,1-3H3,(H,8,9,12)
- InChI Key： FUMMUBNVVHSQCN-UHFFFAOYSA-N
- SMILES： O=C1N(C)C(NC)=NC(N1CC)=O
Computed Properties
- Exact Mass: 184.09616
- Monoisotopic Mass: 184.09602564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 274
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.4
- Topological Polar Surface Area: 65?2
Experimental Properties
- PSA: 65.01
1,3,5-Triazine-2,4(1H,3H)-dione, 3-ethyl-1-methyl-6-(methylamino)- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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